5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one

C7H7N3O2 — CID 11062736

IUPAC5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1cc(=O)n2[nH]ccc2n1
InChIInChI=1S/C7H7N3O2/c1-12-6-4-7(11)10-5(9-6)2-3-8-10/h2-4,8H,1H3
InChIKeyAZEBEGPBYLHTCO-UHFFFAOYSA-N
MW165.15 g/mol
LogP0.03
Rot. Bonds1

About 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 11062736) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID11062736
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1cc(=O)n2[nH]ccc2n1
InChIInChI=1S/C7H7N3O2/c1-12-6-4-7(11)10-5(9-6)2-3-8-10/h2-4,8H,1H3
InChIKeyAZEBEGPBYLHTCO-UHFFFAOYSA-N
XLogP0.03
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Pyrazolo[1,5-a]pyrimidin-7-ol
CID 335418
5-methyl-4H,7H-pyrazolo[1,5-a]pyrimidin-7-one
CID 10534815
5-chloro-4H,7H-pyrazolo[1,5-a]pyrimidin-7-one
CID 13465974
5-Aminopyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 13396556
5-fluoro-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 177088883
2-(trifluoromethoxy)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 178003972
2-(2-methoxyethoxy)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 58190621
5-sulfanyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 58375428
5-ethoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 60075429
1H-pyrazolo[1,5-a]pyrimidin-7-one;hydrochloride
CID 141434045
CID 175999916
CID 175999916
2-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 178003954

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 11062736) is 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one is COc1cc(=O)n2[nH]ccc2n1.
What is the InChIKey of 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is AZEBEGPBYLHTCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c1-12-6-4-7(11)10-5(9-6)2-3-8-10/h2-4,8H,1H3.
What are the key properties of 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 165.15 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 11062736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).